Hopromalinol
AlkaPlorer ID: AK300621
Synonym: 1-[4-[Hexahydro-4-(2-hydroxyheptyl)-5-methyl-2-oxo-1,5-diazocin-1(2H)-yl]butyl]hexahydro-5-methyl-4-phenyl-1,5-diazocin-2(1H)-one
IUPAC Name: 4-(2-hydroxyheptyl)-5-methyl-1-[4-(5-methyl-2-oxo-4-phenyl-1,5-diazocan-1-yl)butyl]-1,5-diazocan-2-one
Structure
SMILES: CCCCCC(O)CC1CC(=O)N(CCCCN2CCCN(C)C(C3=CC=CC=C3)CC2=O)CCCN1C
InChI: InChI=1S/C31H52N4O3/c1-4-5-7-16-28(36)23-27-24-30(37)34(21-12-17-32(27)2)19-10-11-20-35-22-13-18-33(3)29(25-31(35)38)26-14-8-6-9-15-26/h6,8-9,14-15,27-29,36H,4-5,7,10-13,16-25H2,1-3H3
InChIKey: YOIQTGQBNQQIQU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Homalium | Salicaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 528.7820000000003
TPSA？: 67.33
MolLogP？: 4.316200000000004
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|